4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenyl 4-fluorobenzoate
Chemical Structure Depiction of
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenyl 4-fluorobenzoate
4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenyl 4-fluorobenzoate
Compound characteristics
| Compound ID: | 3229-0674 |
| Compound Name: | 4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenyl 4-fluorobenzoate |
| Molecular Weight: | 493.57 |
| Molecular Formula: | C26 H20 F N O4 S2 |
| Smiles: | CCOc1cc(\C=C2/C(N(Cc3ccccc3)C(=S)S2)=O)ccc1OC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6446 |
| logD: | 5.6446 |
| logSw: | -5.5403 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 44.117 |
| InChI Key: | BQFVBCWUPWUXJD-UHFFFAOYSA-N |